SCHEMBL5042423

SCHEMBL5042423

CCOCCOC(=O)c1ccccc1C(=O)OCCOCC

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.69
TSHR P16473 9/20 0.68
TDP1 Q9NUW8 4/20 0.65
L3MBTL1 Q9Y468 3/20 0.65
CYP3A4 P08684 3/20 0.62
MAPK1 P28482 3/20 0.62
TP53 P04637 2/20 0.62
LMNA P02545 1/20 0.61
HSD17B10 Q99714 5/20 0.53
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
CDC25B P30305 1/20 0.49
POLB P06746 1/20 0.49
NPC1 O15118 1/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
HIF1A Q16665 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30818301 1.00 ALDH1A1 (0.69) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL3862755 0.98 ALDH1A1 (0.67) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL5602728 0.98 ALDH1A1 (0.67) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL13839034 0.96 TSHR (0.75) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL6903417 0.93 ALDH1A1 (0.61) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL14672551 0.92 ALDH1A1 (0.59) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL1230521 0.90 TDP1 (0.67) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL29822199 0.90 TSHR (0.59) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL28480438 0.88 TDP1 (0.65) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL11069187 0.88 ALDH1A1 (0.73) ALDH1A1TSHRTDP1L3MBTL1CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 90 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118362657-A Method for measuring various endocrine disruptors in water body 国家地质实验测试中心 2024-07-19 CN claimed
CN-117664947-A Method for rapidly screening phthalate ester environmental hormone in edible oil 武汉食品化妆品检验所 2024-03-08 CN claimed
CN-114814013-B Method for rapidly screening unknown chemical hazard residues in aquatic products based on high-resolution mass spectrum database 中国海洋大学 2023-06-02 CN claimed
CN-115792036-A Method for detecting 16 plasticizers in rosemary leaves by gas chromatography-tandem mass spectrometry 湖南先伟阳光生物科技有限公司 2023-03-14 CN claimed
CN-113388289-A Ink composition and light emitting device including the same 三星显示有限公司 2021-09-14 CN claimed
CN-108333288-B Method for detecting 18 plasticizers in white spirit by gas chromatography-tandem mass spectrometry 绿城农科检测技术有限公司 2021-02-09 CN claimed
CN-112229936-A Method for simultaneously detecting 33 plastic additives in food contact material 南京市产品质量监督检验院 2021-01-15 CN claimed
WO-2016040434-A1 CELLULOSE ESTER PLASTICS AND METHODS AND ARTICLES RELATING THERETO CELANESE ACETATE LLC (US) 2016-03-17 WO claimed
US-6172275-B1 PYROLYSIS; DECHLORINATION KABUSHIKI KAISHA TOSHIBA (JP) 2001-01-09 US claimed
EP-0586575-A1 DEGRADABLE CELLULOSE POLYMERS BATTELLE MEMORIAL INSTITUTE (US) 1994-03-16 EP claimed
WO-1992020738-A1 DEGRADABLE CELLULOSE POLYMERS BATTELLE MEMORIAL INSTITUTE (US) 1992-11-26 WO claimed
EP-3230376-B1 POLY(VINYL ACETAL) RESIN COMPOSITIONS, LAYERS, AND INTERLAYERS HAVING ENHANCED OPTICAL PROPERTIES SOLUTIA INC (US) 2025-09-24 EP disclosed
CN-118362657-A Method for measuring various endocrine disruptors in water body 国家地质实验测试中心 2024-07-19 CN disclosed
CN-117915938-A Methods and compositions for inhibiting dihydroorotate dehydrogenase in combination with anti-CD 47-sirpa therapeutic agents 俄亥俄州国家创新基金会 2024-04-19 CN disclosed
CN-117664947-A Method for rapidly screening phthalate ester environmental hormone in edible oil 武汉食品化妆品检验所 2024-03-08 CN disclosed
EP-0620929-A1 PHOTOGRAPHIC DISPERSION EASTMAN KODAK COMPANY (US) 1994-10-26 EP disclosed
WO-1994011784-A1 PHOTOGRAPHIC DISPERSION EASTMAN KODAK COMPANY (US) 1994-05-26 WO disclosed
US-4005244-A Ultraviolet light curable opacifying compositions PPG INDUSTRIES, INC. (US) 1977-01-25 US disclosed
US-3974080-A PHOSPHORIC ACID ESTER UNION CARBIDE CORPORATION (US) 1976-08-10 US disclosed
US-3971863-A Coated heat fusible injection moldable phenol-aldehyde pellets GENERAL ELECTRIC COMPANY (US) 1976-07-27 US disclosed